General Information of the Compound
| Compound ID |
CP0458190
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| Compound Name |
(2Z)-3-oxo-2-[[4-[4-(1,3,5-triazin-2-yl)piperazine-1-carbonyl]phenyl]methylidene]-1-benzofuran-7-carboxamide
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| Structure |
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| Formula |
C24H20N6O4
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| Molecular Weight |
456.462
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| Canonical SMILES |
NC(=O)c1cccc2C(=O)\C(Oc12)=C\c1ccc(cc1)C(=O)N1CCN(CC1)c1ncncn1
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| InChI |
InChI=1S/C24H20N6O4/c25-22(32)18-3-1-2-17-20(31)19(34-21(17)18)12-15-4-6-16(7-5-15)23(33)29-8-10-30(11-9-29)24-27-13-26-14-28-24/h1-7,12-14H,8-11H2,(H2,25,32)/b19-12-
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| InChIKey |
KJYORNXVEFBFIU-UNOMPAQXSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound